CHEBI:53 - (+)-β-phellandrene

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ChEBI Name (+)-β-phellandrene
ChEBI ID CHEBI:53
ChEBI ASCII Name (+)-beta-phellandrene
Definition A β-phellandrene in which the chiral centre has S configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C10H16
Net Charge 0
Average Mass 136.23404
Monoisotopic Mass 136.12520
InChI InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,6,8,10H,3,5,7H2,1-2H3/t10-/m0/s1
InChIKey LFJQCDVYDGGFCH-JTQLQIEISA-N
SMILES [H][C@]1(CCC(=C)C=C1)C(C)C
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via beta-phellandrene )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (+)-β-phellandrene (CHEBI:53) has role plant metabolite (CHEBI:76924)
(+)-β-phellandrene (CHEBI:53) is a β-phellandrene (CHEBI:48741)
(+)-β-phellandrene (CHEBI:53) is enantiomer of (−)-β-phellandrene (CHEBI:129)
Incoming (−)-β-phellandrene (CHEBI:129) is enantiomer of (+)-β-phellandrene (CHEBI:53)
IUPAC Names
(4S)-p-mentha-1(7),2-diene
(6S)-3-methylidene-6-(propan-2-yl)cyclohex-1-ene
Synonyms Sources
(+)-beta-Phellandrene KEGG COMPOUND
(+)-p-mentha-1(7),2-diene IUPAC
(S)-3-isopropyl-6-methylenecyclohexene ChEBI
Manual Xrefs Databases
C00003052 KNApSAcK
C09877 KEGG COMPOUND
CPD-8769 MetaCyc
HMDB0041634 HMDB
LMPR0102090022 LIPID MAPS
View more database links
Registry Numbers Types Sources
3194593 Reaxys Registry Number Reaxys
3194593 Beilstein Registry Number Beilstein
6153-16-8 CAS Registry Number KEGG COMPOUND
Last Modified
23 October 2015